SCHEMBL16724637

SCHEMBL16724637

COc1cc(-c2cncn2-c2ccc(-c3nc4ccc(F)cc4s3)cc2)ccc1CO

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
APP P05067 13/20 0.44
AHR P35869 1/20 0.43
SULT1A1 P50225 1/20 0.40
CSNK1D P48730 1/20 0.39
MAOB P27338 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16724616 0.91 APP (0.47) APPSULT1A1
SCHEMBL16724618 0.91 AHR (0.43) APPAHRSULT1A1CSNK1DMAOB
SCHEMBL16714471 0.89 AHR (0.55) APPAHRMAOB
SCHEMBL15703332 0.88 APP (0.48) APPAHRMAOB
SCHEMBL16724631 0.88 APP (0.43) APPAHRSULT1A1CSNK1DMAOB
SCHEMBL16724632 0.86 APP (0.49) APPSULT1A1MAOB
SCHEMBL15703532 0.86 APP (0.48) APPAHRMAOB
SCHEMBL16724610 0.85 APP (0.46) APPAHRSULT1A1
SCHEMBL15704220 0.85 APP (0.49) APPAHRMAOB
SCHEMBL16724609 0.84 APP (0.49) APPSULT1A1MAOB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9187467-B2 2-phenyl benzothiazole linked imidazole compounds as potential anticancer agents and process for the preparation thereof COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2015-11-17 US disclosed
US-20150141657-A1 2-PHENYL BENZOTHIAZOLE LINKED IMIDAZOLE COMPOUNDS AS POTENTIAL ANTICANCER AGENTS AND PROCESS FOR THE PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-05-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150141657-A1 2-PHENYL BENZOTHIAZOLE LINKED IMIDAZOLE COMPOUNDS AS POTENTIAL ANTICANCER AGENTS AND PROCESS FOR THE PREPARATION THEREOF NFE2L2, TPT1, CCNT1 APP 3975/4885AHR 869/4885SULT1A1 169/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.